2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide

C17H21NO3S — CID 46828508

IUPAC2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
SMILESCOc1ccccc1OCC(=O)NC(c1cccs1)C(C)C
InChIInChI=1S/C17H21NO3S/c1-12(2)17(15-9-6-10-22-15)18-16(19)11-21-14-8-5-4-7-13(14)20-3/h4-10,12,17H,11H2,1-3H3,(H,18,19)
InChIKeyOHVANLJCKXVRKR-UHFFFAOYSA-N
MW319.43 g/mol
LogP3.65
Rot. Bonds7

About 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide

2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide (PubChem CID 46828508) has the molecular formula C17H21NO3S and a molecular weight of 319.43 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
PubChem CID46828508
Molecular FormulaC17H21NO3S
Molecular Weight319.43 g/mol
Exact Mass319.12
IUPAC Name2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
SMILESCOc1ccccc1OCC(=O)NC(c1cccs1)C(C)C
InChIInChI=1S/C17H21NO3S/c1-12(2)17(15-9-6-10-22-15)18-16(19)11-21-14-8-5-4-7-13(14)20-3/h4-10,12,17H,11H2,1-3H3,(H,18,19)
InChIKeyOHVANLJCKXVRKR-UHFFFAOYSA-N
XLogP3.65
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.43
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
CID 51213896
2-(2-ethoxyphenoxy)-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 7918077
methyl (2R)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoate
CID 113257879
2-[(2-methylpropan-2-yl)oxy]-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide
CID 112604514
N-(2-ethyl-1-thiophen-2-ylbutyl)-2-(2-methoxy-4-methylphenoxy)acetamide
CID 55903263
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
N-[(2R)-1-hydroxypropan-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 39086763
2-(3-methylphenoxy)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]acetamide
CID 9051743
2-(2-propan-2-ylphenoxy)-N-(1-thiophen-2-ylethyl)acetamide
CID 45154352
2-(2-bromophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7847611
2-(2-methoxyphenoxy)-N-pentan-2-ylacetamide
CID 2957379
N-[2-(diethylamino)-2-thiophen-2-ylethyl]-2-(2-methoxyphenoxy)acetamide
CID 112503957

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide (CID 46828508) is 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide is COc1ccccc1OCC(=O)NC(c1cccs1)C(C)C.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide?
The InChIKey is OHVANLJCKXVRKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO3S/c1-12(2)17(15-9-6-10-22-15)18-16(19)11-21-14-8-5-4-7-13(14)20-3/h4-10,12,17H,11H2,1-3H3,(H,18,19).
What are the key properties of 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide?
2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide has a molecular weight of 319.43 g/mol, XLogP of 3.65, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-(2-methyl-1-thiophen-2-ylpropyl)acetamide is sourced from PubChem (CID 46828508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).